3-(acetamidomethylsulfanyl)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]propanamide

Systemtic Name: 3-(acetamidomethylsulfanyl)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]propanamide Openeye Name: 3-(acetamidomethylsulfanyl)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]propanamide CAS Name: 3-(acetamidomethylthio)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]propanamide IUPAC Name: 3-(acetamidomethylsulfanyl)-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]propanamide Traditional Name: 3-(acetamidomethylthio)-N-[5-(diethylsulfamoyl)-2-methoxy-phenyl]propionamide Formula: C17H27N3O5S2 MolecularWeight: 417.54338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)CCSCNC(=O)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)CCSCNC(=O)C

InChI

InChI=1S/C17H27N3O5S2/c1-5-20(6-2)27(23,24)14-7-8-16(25-4)15(11-14)19-17(22)9-10-26-12-18-13(3)21/h7-8,11H,5-6,9-10,12H2,1-4H3,(H,18,21)(H,19,22)